1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine

C14H24N2O — CID 113243107

IUPAC1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine
SMILESCCN1CCC(CNCc2occc2C)CC1
InChIInChI=1S/C14H24N2O/c1-3-16-7-4-13(5-8-16)10-15-11-14-12(2)6-9-17-14/h6,9,13,15H,3-5,7-8,10-11H2,1-2H3
InChIKeyKNPBYHINZFAERY-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.41
Rot. Bonds5

About 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine

1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine (PubChem CID 113243107) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine
PubChem CID113243107
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine
SMILESCCN1CCC(CNCc2occc2C)CC1
InChIInChI=1S/C14H24N2O/c1-3-16-7-4-13(5-8-16)10-15-11-14-12(2)6-9-17-14/h6,9,13,15H,3-5,7-8,10-11H2,1-2H3
InChIKeyKNPBYHINZFAERY-UHFFFAOYSA-N
XLogP2.41
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-[[(1-ethylpiperidin-4-yl)methylamino]methyl]furan-2-yl]methanol
CID 64592569
N-[(3-methylfuran-2-yl)methyl]-1-(4-methylmorpholin-2-yl)methanamine
CID 115653459
1-(1-ethylpiperidin-4-yl)-N-[(1-ethylpyrrol-2-yl)methyl]methanamine
CID 66444793
1-(1-ethylpiperidin-4-yl)-N-[(5-fluoro-2-methylphenyl)methyl]methanamine
CID 115968095
1-(1-ethylpiperidin-4-yl)-N-[(3-methyl-2-pyridinyl)methyl]methanamine
CID 112650123
2-[[(1-ethylpiperidin-4-yl)methylamino]methyl]-4-methylphenol
CID 55203794
2-[[(1-ethylpiperidin-4-yl)methylamino]methyl]aniline
CID 66417480
2-[[(1-ethylpiperidin-4-yl)methylamino]methyl]-6-methylpyridin-3-ol
CID 78943319
1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol
CID 115880131
1-cyclopropyl-2-[(3-methylfuran-2-yl)methylamino]ethanol
CID 115653950
2-cyclohexyl-N-[(3-methylfuran-2-yl)methyl]ethanamine
CID 115651871
1-(1-ethylpyrrolidin-3-yl)-N-(furan-3-ylmethyl)methanamine
CID 63001258

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine?
The IUPAC name of 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine (CID 113243107) is 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine.
What is the SMILES notation for 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine?
The canonical SMILES for 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine is CCN1CCC(CNCc2occc2C)CC1.
What is the InChIKey of 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine?
The InChIKey is KNPBYHINZFAERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-16-7-4-13(5-8-16)10-15-11-14-12(2)6-9-17-14/h6,9,13,15H,3-5,7-8,10-11H2,1-2H3.
What are the key properties of 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine?
1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine has a molecular weight of 236.36 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine is sourced from PubChem (CID 113243107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).